2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-1-[3-(phenylsulfonyl)imidazolidin-1-yl]ethanone

Systemtic Name: 2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-1-[3-(phenylsulfonyl)imidazolidin-1-yl]ethanone Openeye Name: 1-[3-(benzenesulfonyl)imidazolidin-1-yl]-2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]ethanone CAS Name: 1-[3-(benzenesulfonyl)-1-imidazolidinyl]-2-[(6-ethoxy-1,3-benzothiazol-2-yl)thio]ethanone IUPAC Name: 1-[3-(benzenesulfonyl)imidazolidin-1-yl]-2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]ethanone Traditional Name: 1-(3-besylimidazolidin-1-yl)-2-[(6-ethoxy-1,3-benzothiazol-2-yl)thio]ethanone Formula: C20H21N3O4S3 MolecularWeight: 463.59344

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)SCC(=O)N3CCN(C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)SCC(=O)N3CCN(C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C20H21N3O4S3/c1-2-27-15-8-9-17-18(12-15)29-20(21-17)28-13-19(24)22-10-11-23(14-22)30(25,26)16-6-4-3-5-7-16/h3-9,12H,2,10-11,13-14H2,1H3